Benzophenone - CP , CAS No.119-61-9

CAS: 119-61-9 Cat. No.: B103860 Formule: C₁₃H₁₀O Poids moléculaire: 182.22 Beilstein Registry Number: 1238185 Numéro CE: 204-337-6

GRADE & PURITY CP

Synonyms

NSC-8077 | Benzene, benzoyl- | FT-0693251 | BENZOPHENONE (DIPHENYL-KETONE) | Benzophenone (Diphenylmethanone) | Benzophenone, Vetec(TM) reagent grade, 98% | DB01878 | AI3-00754 | EC 204-337-6 | NCGC00090787-06 | NCGC00259974-01 | NSC 8077 | EPA Pesticide

Storage

Protected from light,Room temperature,Desiccated

Shipped In

Normal

Vue d’ensemble

Application：

Photo-crosslinkable bioglue development: A study demonstrated the creation of a surface-independent bioglue using a photo-crosslinkable benzophenone moiety, potentially enhancing medical adhesives for diverse applications.
Organic explosive trace analysis: Research highlighted the use of benzophenone for improved preconcentration and analysis of organic explosive traces in aqueous samples, advancing forensic methodologies.
OLEDs blue emitters: A publication introduced bicarbazole-benzophenone based twisted donor-acceptor derivatives as potential blue TADF emitters for OLED applications, showcasing the versatility of benzophenone in electronic devices.
Photodynamic antibacterial nonwovens: Research focused on the modification of traditional composite nonwovens with benzophenone to enable stable storage of light absorption transients and enhance photodynamic antibacterial effects, contributing to medical textile innovations.

Specifications

Synonymes

NSC-8077 | Benzene, benzoyl- | FT-0693251 | BENZOPHENONE (DIPHENYL-KETONE) | Benzophenone (Diphenylmethanone) | Benzophenone, Vetec(TM) reagent grade, 98% | DB01878 | AI3-00754 | EC 204-337-6 | NCGC00090787-06 | NCGC00259974-01 | NSC 8077 | EPA Pesticide

Spécifications et pureté

CP

Conditions de stockage de stockage

Protected from light,Room temperature,Desiccated

Expédié en

Normal

Grade

CP

Noms et identifiants

Pubchem Sid

508812303

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508812303

Sourires canoniques

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

IUPAC Name

diphenylmethanone

InChIKey

RWCCWEUUXYIKHB-UHFFFAOYSA-N

INCHI

1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H

Isomères SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

WGK Allemagne

2

RTECS

DI9950000

Numéro ONU

1224

Groupe d'emballage

I

Poids moléculaire

182.22

Beilstein

1238185

Reaxy-Rn

1238185

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1238185&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzophenones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: Diphenylmethanes Aryl-phenylketones Benzoyl derivatives Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Aryl-phenylketone - Diphenylmethane - Aryl ketone - Benzoyl - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
• External Descriptors: benzophenones

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

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CTSG Tchem Cathepsin G (2304 Activities)

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HepG2 (196354 Activities)

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CCF-STTG1 (114 Activities)

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Cibles associées (non humaines)

Papain (844 Activities)

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: benzene, alcohol, ether, chloroform, acetone
• Sensibilité: Light sensitive.
• Point d'éclair (°F): 280°F
• Point d'éclair (°C): 138 °C - closed cup
• Point d'ébullition (°C): 305 °C (lit.)
• Point de fusion (°C): 47-51 °C (lit.)
• Poids moléculaire: 182.220 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 182.073 Da
• Monoisotopic Mass: 182.073 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 165.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1